[(R)-cyano-(2-methyl-4H-1,3-benzodioxin-6-yl)methyl] ethanoate

Systemtic Name: [(R)-cyano-(2-methyl-4H-1,3-benzodioxin-6-yl)methyl] ethanoate Openeye Name: [(R)-cyano-(2-methyl-4H-1,3-benzodioxin-6-yl)methyl] acetate CAS Name: acetic acid [(R)-cyano-(2-methyl-4H-1,3-benzodioxin-6-yl)methyl] ester IUPAC Name: [(R)-cyano-(2-methyl-4H-1,3-benzodioxin-6-yl)methyl] acetate Traditional Name: acetic acid [(R)-cyano-(2-methyl-4H-1,3-benzodioxin-6-yl)methyl] ester Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CC1OCC2=C(O1)C=CC(=C2)C(C#N)OC(=O)C

Isomeric SMILES

CC1OCC2=C(O1)C=CC(=C2)[C@H](C#N)OC(=O)C

InChI

InChI=1S/C13H13NO4/c1-8(15)17-13(6-14)10-3-4-12-11(5-10)7-16-9(2)18-12/h3-5,9,13H,7H2,1-2H3/t9?,13-/m0/s1